Hydrochloric Acid

Hydrochloric Acid

SCHEMBL17743591

CCN(CC)c1ccc2c(c1)-c1cc(N(CC)CC)ccc1C2[Zr](C1=CC=CC1)=C(c1ccccc1)c1ccccc1.Cl.Cl

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB known ✓ P27338 1/20 0.31
GAA known ✓ P10253 1/20 0.31
HDAC6 known ✓ Q9UBN7 1/20 0.30
CNR2 P34972 1/20 0.33
MAPT P10636 5/20 0.32
MEN1 O00255 4/20 0.32
KMT2A Q03164 4/20 0.32
LMNA P02545 2/20 0.32
ALDH1A1 P00352 5/20 0.32
CYP3A4 P08684 1/20 0.32
L3MBTL1 Q9Y468 3/20 0.31
NPC1 O15118 1/20 0.31
GRK6 P43250 1/20 0.31
RAB9A P51151 1/20 0.31
HIF1A Q16665 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MAPK1 P28482 2/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
USP2 O75604 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL17743592 0.93 HTR7 (0.31) CNR2
Hydrochloric Acid SCHEMBL17743557 0.92 MEN1 (0.32) CNR2MAPTMEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL17743597 0.91 MEN1 (0.31) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL8160551 0.90 MAPT (0.33) CNR2MAPTMEN1KMT2ALMNA
SCHEMBL8153894 0.90 MEN1 (0.31) MAPTMEN1KMT2ALMNAALDH1A1
Hydrochloric Acid SCHEMBL17743499 0.88 RAB9A (0.34) MAPTMEN1KMT2AALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL17743511 0.86 MEN1 (0.30) MAPTMEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL17743599 0.82 KDM4E (0.35) CNR2MEN1KMT2AALDH1A1GAA
Hydrochloric Acid SCHEMBL17782127 0.82 KDM4E (0.31) KDM4E
Hydrochloric Acid SCHEMBL17743530 0.81 PTPN1 (0.33) SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3020736-B1 ULTRA-HIGH-MOLECULAR-WEIGHT POLYETHYLENE PARTICLES AND MOLDED BODY COMPRISING SAME TOSOH CORP (JP) 2020-09-09 EP disclosed
US-10340492-B2 Ultrahigh molecular weight polyethylene stretched porous film TOSOH CORPORATION (JP) 2019-07-02 US disclosed
US-10316119-B2 Ultrahigh molecular weight polyethylene particles and molded product made thereof TOSOH CORPORATION (JP) 2019-06-11 US disclosed
US-20170125763-A1 ULTRAHIGH MOLECULAR WEIGHT POLYETHYLENE STRETCHED POROUS FILM TOSOH CORPORATION (JP) 2017-05-04 US disclosed
US-20160152744-A1 ULTRAHIGH MOLECULAR WEIGHT POLYETHYLENE PARTICLES AND MOLDED PRODUCT MADE THEREOF TOSOH CORPORATION (JP) 2016-06-02 US disclosed
EP-3020736-A1 ULTRA-HIGH-MOLECULAR-WEIGHT POLYETHYLENE PARTICLES AND MOLDED BODY COMPRISING SAME Tosoh Corporation (JP) 2016-05-18 EP disclosed